SCHEMBL9761379

SCHEMBL9761379

CSc1cc(C=O)cc(Oc2ccccc2)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 4/20 0.51
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
ERN1 O75460 1/20 0.41
ALDH1A1 P00352 3/20 0.36
TRIM24 O15164 1/20 0.36
HPGD P15428 1/20 0.36
ALDH5A1 P51649 1/20 0.36
ABAT P80404 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
TSHR P16473 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CAMK2A Q9UQM7 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9102503 0.80 MAOA (0.46) LMNAERN1ALDH1A1TDP1CYP2C9
SCHEMBL1515822 0.75 KDM4E (0.57) LMNAGAAKMT2AALDH1A1HPGD
SCHEMBL5605402 0.74 TTR (0.48) TTRKMT2AERN1ALDH1A1TRIM24
SCHEMBL6062329 0.72 TTR (0.64) TTRLMNAGAAKMT2AALDH1A1
SCHEMBL6509216 0.71 TTR (0.47) TTRLMNAGAAKMT2AALDH1A1
SCHEMBL11795573 0.70 TTR (0.81) TTRLMNAGAAKMT2AALDH1A1
SCHEMBL29446607 0.70 TTR (0.81) TTRLMNAGAAKMT2AALDH1A1
SCHEMBL4945903 0.69 TTR (0.69) TTRLMNAGAAKMT2AERN1
SCHEMBL15445427 0.69 TTR (0.69) TTRLMNAGAAKMT2AALDH1A1
SCHEMBL7263488 0.69 TTR (0.64) TTRLMNAGAAKMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001123-A 2,5-diaryl tetrahydrofurans and analogs thereof as PAF antagonists MERCK & CO., INC. (US) 1991-03-19 US disclosed